SMILES:
CCCN(CCC)CCCCN(CC(=O)OCCOCCO)Cc1ccc(CN(Cc2ncc[nH]2)Cc2nccn2C)cc1Molecular Processing
Molecular formula
C33H53N7O4
Molecular weight
611.83
Exact mass
611.4159
XLogP
3.6
TPSA
111.98
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
24
Heavy atoms
44
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.606
Molar refractivity
171.59
Supplementary Information
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